2-[(3-fluorophenyl)methylsulfanyl]-3-(phenylmethyl)pteridin-4-one

Systemtic Name: 2-[(3-fluorophenyl)methylsulfanyl]-3-(phenylmethyl)pteridin-4-one Openeye Name: 3-benzyl-2-[(3-fluorophenyl)methylsulfanyl]pteridin-4-one CAS Name: 2-[(3-fluorophenyl)methylthio]-3-(phenylmethyl)-4-pteridinone IUPAC Name: 3-benzyl-2-[(3-fluorophenyl)methylsulfanyl]pteridin-4-one Traditional Name: 3-benzyl-2-[(3-fluorobenzyl)thio]pteridin-4-one Formula: C20H15FN4OS MolecularWeight: 378.422703

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=NC=CN=C3N=C2SCC4=CC(=CC=C4)F

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=NC=CN=C3N=C2SCC4=CC(=CC=C4)F

InChI

InChI=1S/C20H15FN4OS/c21-16-8-4-7-15(11-16)13-27-20-24-18-17(22-9-10-23-18)19(26)25(20)12-14-5-2-1-3-6-14/h1-11H,12-13H2